3-(dodecanoylamino)-2,4,6-tris(iodanyl)benzoic acid

Systemtic Name: 3-(dodecanoylamino)-2,4,6-tris(iodanyl)benzoic acid Openeye Name: 3-(dodecanoylamino)-2,4,6-triiodo-benzoic acid CAS Name: 2,4,6-triiodo-3-(1-oxododecylamino)benzoic acid IUPAC Name: 3-(dodecanoylamino)-2,4,6-triiodobenzoic acid Traditional Name: 2,4,6-triiodo-3-(lauroylamino)benzoic acid Formula: C19H26I3NO3 MolecularWeight: 697.12805

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I

InChI

InChI=1S/C19H26I3NO3/c1-2-3-4-5-6-7-8-9-10-11-15(24)23-18-14(21)12-13(20)16(17(18)22)19(25)26/h12H,2-11H2,1H3,(H,23,24)(H,25,26)